Chem
J-GLOBAL ID：201007006824153050   Nikkaji number：J2.792.562F

9-Fluoro-11β,17β-dihydroxy-16α-methylandrosta-1,4-dien-3-one

9-フルオロ-11β,17β-ジヒドロキシ-16α-メチルアンドロスタ-1,4-ジエン-3-オン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C20H27FO3
Molecular formula furigana： C20-H27-F-O3
Molecular weight： 334.431
InChI： InChI=1S/C20H27FO3/c1-11-8-15-14-5-4-12-9-13(22)6-7-19(12,3)20(14,21)16(23)10-18(15,2)17(11)24/h6-7,9,11,14-17,23-24H,4-5,8,10H2,1-3H3/t11-,14+,15+,16+,17+,18+,19+,20+/m1/s1
InChI key： KRJYQZVCFICBNU-NBLXTBOZSA-N
SMILES： C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@H]1O
Systematic name  (3)：
  • 9-フルオロ-11β,17β-ジヒドロキシ-16α-メチルアンドロスタ-1,4-ジエン-3-オン
  • (1S,2R,3aS,3bS,9aS,9bR,10S,11aS)-9b-フルオロ-1,10-ジヒドロキシ-2,9a,11a-トリメチル-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-7-オン
  • (1S,2R,3aS,3bS,9aS,9bR,10S,11aS)-9b-fluoro-1,10-dihydroxy-2,9a,11a-trimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
Other name (2)：
  • 9-Fluoro-11β,17β-dihydroxy-16α-methylandrosta-1,4-diene-3-one
  • 9-Fluoro-11β,17β-dihydroxy-16α-methylandrosta-1,4-dien-3-one
CAS registry number： 3801-25-0
KEGG COMPOUND： C15092
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